DASATINIB MONOHYDRATE

CAS No.
863127-77-9
CCD No.
CCD00691961
Formula
C22 H26 Cl N7 O2 S . H2 O
MolWeight
506.028

Basic Information

Product Name: DASATINIB MONOHYDRATE
CAS: 863127-77-9
English Synonyms: N-(2-CHLORO-6-METHYLPHENYL)-2-(6-(4-(2-HYDROXYETHYL)PIPERAZIN-1-YL)-2-METHYLPYRIMIDIN-4-YLAMINO)THIAZOLE-5-CARBOXAMIDE HYDRATE ; N-(2-CHLORO-6-METHYLPHENYL)-2-((6-(4-(2-HYDROXYETHYL)-1-PIPERAZINYL)-2-METHYL-4-PYRIMIDINYL)AMINO)-5-THIAZOLECARBOXAMIDE MONOHYDRATE ; DASATINIB MONOHYDRATE ; DASATINIB HYDRATE
MDL Number.: MFCD08704581
H bond acceptor: 9
H bond donor: 3
Smile: Cc1cccc(c1NC(=O)c2cnc(s2)Nc3cc(nc(n3)C)N4CCN(CC4)CCO)Cl.O
InChi: InChI=1S/C22H26ClN7O2S.H2O/c1-14-4-3-5-16(23)20(14)28-21(32)17-13-24-22(33-17)27-18-12-19(26-15(2)25-18)30-8-6-29(7-9-30)10-11-31;/h3-5,12-13,31H,6-11H2,1-2H3,(H,28,32)(H,24,25,26,27);1H2
InChiKey: InChIKey=XHXFZZNHDVTMLI-UHFFFAOYSA-N

Property

Comments: HAZARD: R 22-48/22-61
HAZARD: S 53-20-36-45-60
UNSPSC: 12000000

Safety information

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